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PSUBSSIBELYCSE-UHFFFAOYSA-N

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PSUBSSIBELYCSE-UHFFFAOYSA-N
SpectraBase Compound ID HuM5ab2N7zj
InChI InChI=1S/C36H11BO4Si3.6C5H.6Fe/c1-2-16-30(17-3-1)37-38-42(31-18-4-5-19-31,32-20-6-7-21-32)40-44(35-26-12-13-27-35,36-28-14-15-29-36)41-43(39-37,33-22-8-9-23-33)34-24-10-11-25-34;6*1-2-4-5-3-1;;;;;;/h1-3,16-18,20,22,24,26,28H;6*1H;;;;;;
InChIKey PSUBSSIBELYCSE-UHFFFAOYSA-N
Mol Weight 1304.0 g/mol
Molecular Formula C66H17BFe6O4Si3
Exact Mass 1303.662385 g/mol

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2CiMCsQojlR
Name PSUBSSIBELYCSE-UHFFFAOYSA-N
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C66H17BFe6O4Si3
InChI InChI=1S/C36H11BO4Si3.6C5H.6Fe/c1-2-16-30(17-3-1)37-38-42(31-18-4-5-19-31,32-20-6-7-21-32)40-44(35-26-12-13-27-35,36-28-14-15-29-36)41-43(39-37,33-22-8-9-23-33)34-24-10-11-25-34;6*1-2-4-5-3-1;;;;;;/h1-3,16-18,20,22,24,26,28H;6*1H;;;;;;
InChIKey PSUBSSIBELYCSE-UHFFFAOYSA-N
Literature Reference Author K.THIEME,S.C.BOURKE,J.ZHENG,M.J.MACLACHLAN,F.ZAMANIAN,A.J.LO UGH,I.MANNERS
Literature Reference Citation CAN.J.CHEM.,80,1469(2002)
Literature Reference DOI 10.1139/v02-129
Solvent C6D6
Source File Reference UWMS28768